![2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one structure](/static/products/852/852174-41-5.png)
2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one
TL;DR: 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one (CAS 852174-41-5) is a chemical compound with molecular formula C24H28N2O5S and molecular weight 456.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone
Also Known As: 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one, 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone, 2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethanone
| Molecular Formula | C24H28N2O5S |
|---|---|
| Molecular Weight | 456.17 g/mol |
| LogP | 2.9238 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 456.1719 |
| Heavy Atoms | 32 |
| Complexity | 1104.4645 |
Chemical Identifiers
| CAS Number | 852174-41-5 |
|---|---|
| SMILES | CC1(CC2=C(O1)C(=CC=C2)OCC(=O)N3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4)C |
Product Overview
2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one (CAS 852174-41-5), with molecular formula C24H28N2O5S and molecular weight 456.17 g/mol. IUPAC: 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone.
Chemical Property Profile of 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one
Property Insights of 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one
The XLogP value of 2.9238 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one. Following Lipinski's Rule of Five, 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one?
The CAS number of 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one is 852174-41-5.
What is the molecular formula of 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one?
The molecular formula of 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one is C24H28N2O5S.
What is the molecular weight of 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one?
The molecular weight of 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one is 456.17 g/mol.
Where can I buy 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one?
You can request a quote for 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-1-[4-(2-phenylethenesulfonyl)piperazin-1-yl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.